DoGSiteScorer: a web server for automatic binding site prediction, analysis and druggability assessment

Many drug discovery projects fail because the underlying target is finally found to be undruggable. Progress in structure elucidation of proteins now opens up a route to automatic structure-based target assessment. DoGSiteScorer is a newly developed automatic tool combining pocket prediction, charac...

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Veröffentlicht in:	Bioinformatics 2012-08, Vol.28 (15), p.2074-2075
Hauptverfasser:	VOLKAMER, Andrea, KUHN, Daniel, RIPPMANN, Friedrich, RAREY, Matthias
Format:	Artikel
Sprache:	eng
Schlagworte:	Assessments Binding Sites Bioinformatics Biological and medical sciences Computational Biology - methods Drug Discovery - methods Fundamental and applied biological sciences. Psychology General aspects Internet Mathematics in biology. Statistical analysis. Models. Metrology. Data processing in biology (general aspects) Pocket Proteins Proteins - chemistry Servers (computers) Software User-Computer Interface World Wide Web
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Beschreibung
Zusammenfassung:	Many drug discovery projects fail because the underlying target is finally found to be undruggable. Progress in structure elucidation of proteins now opens up a route to automatic structure-based target assessment. DoGSiteScorer is a newly developed automatic tool combining pocket prediction, characterization and druggability estimation and is now available through a web server. The DoGSiteScorer web server is freely available for academic use at http://dogsite.zbh.uni-hamburg.de rarey@zbh.uni-hamburg.de.
ISSN:	1367-4803 1367-4811 1460-2059
DOI:	10.1093/bioinformatics/bts310